SCHEMBL7644170

SCHEMBL7644170

CCOC(=O)c1cccc(Cl)c1-c1ccc(C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.53
BAZ2B Q9UIF8 1/20 0.50
BAZ2A Q9UIF9 1/20 0.50
MAPT P10636 5/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
USP2 O75604 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
ALOX15 P16050 1/20 0.47
CYP2C19 P33261 1/20 0.47
MAPK10 P53779 1/20 0.47
PTK2B Q14289 1/20 0.47
NCOA1 Q15788 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
ALDH1A1 P00352 3/20 0.46
HSD17B10 Q99714 1/20 0.46
HTT P42858 1/20 0.46
LMNA P02545 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7639368 0.90 TSHR (0.59) TSHRBAZ2BBAZ2AMAPTMEN1
SCHEMBL7642334 0.87 GAA (0.54) TSHRMAPTMEN1KMT2ACYP1A2
SCHEMBL7635078 0.86 CASP1 (0.55) TSHRBAZ2BBAZ2AMAPTMEN1
SCHEMBL7642362 0.85 SLC6A4 (0.49) TSHRMAPTMEN1KMT2ACYP1A2
SCHEMBL7637488 0.84 MAPT (0.59) TSHRMAPTNPSR1L3MBTL1GAA
SCHEMBL7636152 0.80 RAB9A (0.51) TSHRMAPTMEN1KMT2AALDH1A1
SCHEMBL7641404 0.78 MAPT (0.56) TSHRMAPTMEN1KMT2AUSP2
SCHEMBL2601348 0.78 TSHR (0.63) TSHRBAZ2BBAZ2AMAPTMEN1
SCHEMBL11418791 0.78 TSHR (0.63) TSHRBAZ2BBAZ2AMAPTMEN1
SCHEMBL406428 0.77 TSHR (0.74) TSHRBAZ2BBAZ2AMAPTALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6340772-B2 AROMATIZATION OF CYCLOHEXENONE DERIVATIVES VIA (CHLORO)CYCLOHEXADIENE NIPPON KAYAKU CO., LTD. (JP) 2002-01-22 US disclosed
US-20010020112-A1 Process for preparing (hetero) aromatic substituted benzene derivatives TOYA TETSUYA (JP) 2001-09-06 US disclosed
US-6271418-B1 AROMATIZATION OF CYCLOHEXENONE DERIVATIVES VIA (CHLORO)CYCLOHEXADIENE DERIVATIVES. NIPPON KAYAKU CO., LTD. (JP) 2001-08-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010020112-A1 Process for preparing (hetero) aromatic substituted benzene derivatives AHR, CYP3A4, CYP4B1 TSHR 4332/4885BAZ2B 834/4885BAZ2A 1286/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.